4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-7-carboxylic acid

Systemtic Name: 4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-7-carboxylic acid Openeye Name: 4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromene-7-carboxylic acid CAS Name: 4,4-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-7-carboxylic acid IUPAC Name: 4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromene-7-carboxylic acid Traditional Name: 1,1-diketo-4,4-dimethyl-2,3-dihydrothiochromene-7-carboxylic acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C2=C1C=CC(=C2)C(=O)O)C

Isomeric SMILES

CC1(CCS(=O)(=O)C2=C1C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C12H14O4S/c1-12(2)5-6-17(15,16)10-7-8(11(13)14)3-4-9(10)12/h3-4,7H,5-6H2,1-2H3,(H,13,14)